2-ethoxy-N,2-dimethyl-1-(3-propan-2-yloxyphenyl)propan-1-amine

C16H27NO2 — CID 116726622

IUPAC2-ethoxy-N,2-dimethyl-1-(3-propan-2-yloxyphenyl)propan-1-amine
SMILESCCOC(C)(C)C(NC)c1cccc(OC(C)C)c1
InChIInChI=1S/C16H27NO2/c1-7-18-16(4,5)15(17-6)13-9-8-10-14(11-13)19-12(2)3/h8-12,15,17H,7H2,1-6H3
InChIKeyDRNOVWPDLGSLSQ-UHFFFAOYSA-N
MW265.40 g/mol
LogP3.55
Rot. Bonds7

About 2-ethoxy-N,2-dimethyl-1-(3-propan-2-yloxyphenyl)propan-1-amine

2-ethoxy-N,2-dimethyl-1-(3-propan-2-yloxyphenyl)propan-1-amine (PubChem CID 116726622) has the molecular formula C16H27NO2 and a molecular weight of 265.40 g/mol. Its IUPAC name is 2-ethoxy-N,2-dimethyl-1-(3-propan-2-yloxyphenyl)propan-1-amine.

Molecular Properties

Compound Name2-ethoxy-N,2-dimethyl-1-(3-propan-2-yloxyphenyl)propan-1-amine
PubChem CID116726622
Molecular FormulaC16H27NO2
Molecular Weight265.40 g/mol
Exact Mass265.20
IUPAC Name2-ethoxy-N,2-dimethyl-1-(3-propan-2-yloxyphenyl)propan-1-amine
SMILESCCOC(C)(C)C(NC)c1cccc(OC(C)C)c1
InChIInChI=1S/C16H27NO2/c1-7-18-16(4,5)15(17-6)13-9-8-10-14(11-13)19-12(2)3/h8-12,15,17H,7H2,1-6H3
InChIKeyDRNOVWPDLGSLSQ-UHFFFAOYSA-N
XLogP3.55
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.40
LogP ≤ 53.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-ethoxy-N,2-dimethyl-1-(3-propan-2-yloxyphenyl)propan-1-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-ethoxy-1-(3-ethoxyphenyl)-2-ethyl-N-methylbutan-1-amine
CID 116759943
ethyl 2-(methylamino)-2-(3-propan-2-yloxyphenyl)acetate
CID 61212076
2-methoxy-N-methyl-1-(3-propan-2-yloxyphenyl)butan-1-amine
CID 116715521
N-ethyl-3-methoxy-3-methyl-1-(3-propan-2-yloxyphenyl)butan-1-amine
CID 103028638
2-ethoxy-3,3-dimethyl-1-(3-propan-2-yloxyphenyl)butan-1-amine
CID 116725346
N-tert-butyl-2-methyl-3-(3-propan-2-yloxyphenyl)butan-1-amine
CID 81015863
5,5,5-trifluoro-N-methyl-1-(3-propan-2-yloxyphenyl)pentan-1-amine
CID 105024061
2-cyclobutyl-N-methyl-1-(3-propan-2-yloxyphenyl)ethanamine
CID 115863611
(1S)-1-(3-propan-2-yloxyphenyl)ethanol
CID 75358098
2-(4-bromophenyl)-N-methyl-1-(3-propan-2-yloxyphenyl)ethanamine
CID 63527212
2-(butan-2-ylamino)-2-(3-propan-2-yloxyphenyl)acetonitrile
CID 61210762
1-(2,6-dichlorophenyl)-N-methyl-1-(3-propan-2-yloxyphenyl)methanamine
CID 105019039

Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-N,2-dimethyl-1-(3-propan-2-yloxyphenyl)propan-1-amine?
The IUPAC name of 2-ethoxy-N,2-dimethyl-1-(3-propan-2-yloxyphenyl)propan-1-amine (CID 116726622) is 2-ethoxy-N,2-dimethyl-1-(3-propan-2-yloxyphenyl)propan-1-amine.
What is the SMILES notation for 2-ethoxy-N,2-dimethyl-1-(3-propan-2-yloxyphenyl)propan-1-amine?
The canonical SMILES for 2-ethoxy-N,2-dimethyl-1-(3-propan-2-yloxyphenyl)propan-1-amine is CCOC(C)(C)C(NC)c1cccc(OC(C)C)c1.
What is the InChIKey of 2-ethoxy-N,2-dimethyl-1-(3-propan-2-yloxyphenyl)propan-1-amine?
The InChIKey is DRNOVWPDLGSLSQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H27NO2/c1-7-18-16(4,5)15(17-6)13-9-8-10-14(11-13)19-12(2)3/h8-12,15,17H,7H2,1-6H3.
What are the key properties of 2-ethoxy-N,2-dimethyl-1-(3-propan-2-yloxyphenyl)propan-1-amine?
2-ethoxy-N,2-dimethyl-1-(3-propan-2-yloxyphenyl)propan-1-amine has a molecular weight of 265.40 g/mol, XLogP of 3.55, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-N,2-dimethyl-1-(3-propan-2-yloxyphenyl)propan-1-amine is sourced from PubChem (CID 116726622), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).